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Oxygen K-edge X-ray absorption spectra of liquid water are computed based on the configurations from advanced ab initio molecular dynamics simulations, as well as an electron excitation theory from the GW method. One one hand, the molecular…
A dual watermarking scheme based on Sobolev type orthogonal moments, Charlier and Meixner, is proposed based on different discrete measures. The existing relation through the connection formulas allows to provide with structure and…
We study the convergence rate of Bregman gradient methods for convex optimization in the space of measures on a $d$-dimensional manifold. Under basic regularity assumptions, we show that the suboptimality gap at iteration $k$ is in…
This paper introduces a new generalized polynomial chaos expansion (PCE) comprising measure-consistent multivariate orthonormal polynomials in dependent random variables. Unlike existing PCEs, whether classical or generalized, no…
We construct bivariate orthogonal polynomials (OPs) on algebraic curves of the form $y^m = \phi(x)$ in $\mathbb{R}^2$ where $m = 1, 2$ and $\phi$ is a polynomial of arbitrary degree $d$, in terms of univariate semiclassical OPs. We compute…
The proximal bundle method (PBM) is a fundamental and computationally effective algorithm for solving nonsmooth optimization problems. In this paper, we present the first variant of the PBM for smooth objectives, achieving an accelerated…
Mixture modeling is a general technique for making any simple model more expressive through weighted combination. This generality and simplicity in part explains the success of the Expectation Maximization (EM) algorithm, in which updates…
The operational calculus associated with special polynomials has proven to be a powerful tool for analyzing and simplifying their properties. This article examines the bivariate degenerate Hermite polynomials with a focus on their…
We introduce quantitative and robust tools to control the numerical accuracy in simulations performed using the Multiscale Finite Element Method (MsFEM). First, we propose a guaranteed and fully computable a posteriori error estimate for…
This article presents a priori error estimates of the miscible displacement of one compressible fluid by another in a porous medium. The study utilizes the $H(\rm div)$ conforming virtual element method (VEM) for the approximation of the…
In this paper, we present a wideband subspace estimation method that characterizes the signal subspace through its orthogonal projection matrix at each frequency. Fundamentally, the method models this projection matrix as a function of…
This article deals with quantitative error analysis resulting from ellipsometric data obtained from measurement on curved surfaces including the influence of non-collimated beams. Numerical model based on the combination of geometrical and…
In this paper, we propose and analyze the extrapolation method and asymptotically exact a posterior error estimate for eigenvalues of the Morley element. We establish an asymptotic expansion of eigenvalues, and prove an optimal result for…
Spectral decomposition of linear operators plays a central role in many areas of machine learning and scientific computing. Recent work has explored training neural networks to approximate eigenfunctions of such operators, enabling scalable…
For the 2D and 3D Virtual Element Methods (VEM), a new approach to improve the conditioning of local and global matrices in the presence of badly-shaped polytopes is proposed. It defines the local projectors and the local degrees of freedom…
For the nonparametric regression models with covariates contaminated with normal measurement errors, this paper proposes an extrapolation algorithm to estimate the nonparametric regression functions. By applying the conditional expectation…
In this paper, we obtain global $\mathcal{O} (1/ \sqrt{k})$ pointwise and $\mathcal{O} (1/ {k})$ ergodic convergence rates for a variable metric proximal alternating direction method of multipliers(VM-PADMM) for solving linearly constrained…
The Stochastic Approximation EM (SAEM) algorithm, a variant stochastic approximation of EM, is a versatile tool for inference in incomplete data models. In this paper, we review the fundamental EM algorithm and then focus especially on the…
This paper explores the possibilities and limitations of error correction by the structural simplicity of error mechanisms. Specifically, we consider channel models, called \emph{samplable additive channels}, in which (a) errors are…
This paper introduces a novel error estimator for the Proper Generalized Decomposition (PGD) approximation of parametrized equations. The estimator is intrinsically random: It builds on concentration inequalities of Gaussian maps and an…